Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.46 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.46 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | JAK3 | P52333 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | STK4 | Q13043 | 3/20 | 0.38 |
| ▸ | STK3 | Q13188 | 3/20 | 0.38 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2123449 | 0.69 | PIK3CA (0.40) | CHEK1KDM4EALDH1A1GAAMEN1 | |
| SCHEMBL10964391 | 0.67 | KDM4E (0.46) | MAPK1CHEK1PDPK1PAK1KDM4E | |
| SCHEMBL9158913 | 0.65 | KDM4E (0.82) | MAPK1CHEK1PDPK1PAK1KDM4E | |
| SCHEMBL19241974 | 0.64 | KDM4E (0.54) | MAPK1CHEK1PDPK1PAK1KDM4E | |
| SCHEMBL29804858 | 0.64 | CHEK1 (0.60) | MAPK1CHEK1PDPK1PAK1KDM4E | |
| SCHEMBL336612 | 0.64 | CHEK1 (0.60) | MAPK1CHEK1PDPK1PAK1KDM4E | |
| SCHEMBL2125523 | 0.64 | L3MBTL1 (0.40) | ALDH1A1GAAMEN1KMT2ALMNA | |
| SCHEMBL24541949 | 0.63 | KDM4E (0.49) | MAPK1CHEK1PDPK1PAK1KDM4E | |
| SCHEMBL336613 | 0.63 | MAPK1 (1.00) | MAPK1CHEK1PDPK1PAK1LMNA | |
| SCHEMBL13828331 | 0.63 | TLR7 (0.57) | MAPK1CHEK1PDPK1PAK1KDM4E |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105859735-A | TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE | 霍夫曼-拉罗奇有限公司 | 2016-08-17 | — | — | CN | disclosed |
| CN-103313989-B | tricyclic PI3K inhibitor compounds and methods of use | HOFFMAN-LA ROCHE LTD. (CH) | 2016-05-04 | — | — | CN | disclosed |
| CN-103313989-A | Tricyclic PI3K inhibitor compounds and methods of use | HOFFMANN LA ROCHE | 2013-09-18 | — | — | CN | disclosed |